{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8221993 -1.643627 -1.0964417 ] [ -0.4834748 -1.291568 0.0216174 ] [ 0.8449709 -0.6177818 -0.7367108 ] [ -0.6791075 0.5812944 -1.9604392 ] [ 7.8038007 -2.1927508 -0.7514192 ] [ -5.4616015 7.8716609 -3.7218257 ] [ 0.7976116 -2.7072275 8.2452191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.521661737698125e-09 -2.633380752715641e-09 -1.756693257810207e-09 ] [ -7.746120213059558e-10 -2.069320053773414e-09 3.463489288248192e-11 ] [ 1.353792621236335e-09 -9.897955567157415e-10 -1.180340820050865e-09 ] [ -1.088050159509936e-09 9.313362974819634e-10 -3.140969852739856e-09 ] [ 1.250306703492267e-08 -3.513174067000497e-09 -1.203906274660239e-09 ] [ -8.750450235426214e-09 1.261179106084549e-08 -5.963022123232595e-09 ] [ 1.277914657998881e-09 -4.337456607686832e-09 1.321029727539362e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.761492 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.845704723292624e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9634573 2.289759 2.9139808 ] [ 3.5583849 1.7117214 1.1633122 ] [ 4.2780684 1.5270352 3.5560512 ] [ 3.5155615 4.0374235 0.5111434 ] [ 5.138553 3.3707066 2.2132137 ] [ 3.0349453 4.531843 2.8501449 ] [ 3.1141936 3.1802612 4.878279 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9634573e-10 2.289759e-10 2.9139808e-10 ] [ 3.5583849e-10 1.7117214e-10 1.1633122e-10 ] [ 4.278068400000001e-10 1.5270352e-10 3.556051200000001e-10 ] [ 3.5155615e-10 4.0374235e-10 5.111434e-11 ] [ 5.138553e-10 3.3707066e-10 2.2132137e-10 ] [ 3.0349453e-10 4.531843000000001e-10 2.8501449e-10 ] [ 3.1141936e-10 3.1802612e-10 4.878279e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.78e-05 2.03e-05 -1.71e-05 ] [ 1.5e-06 1.97e-05 -7.5e-06 ] [ 1.65e-05 3.16e-05 7.4e-06 ] [ -3.1e-06 -1.14e-05 1.07e-05 ] [ -2.02e-05 -3.89e-05 -5.7e-06 ] [ -5.5e-06 -2.65e-05 2.25e-05 ] [ -7.1e-06 5.2e-06 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.851874385024e-14 3.252418540224e-14 -2.739722021568e-14 ] [ 2.4032649312e-15 3.156287942976e-14 -1.2016324656e-14 ] [ 2.64359142432e-14 5.062878121728e-14 1.185610699392e-14 ] [ -4.96674752448e-15 -1.826481347712e-14 1.714328984256e-14 ] [ -3.236396774016e-14 -6.232467054911999e-14 -9.13240673856e-15 ] [ -8.8119714144e-15 -4.24576804512e-14 3.604897396800001e-14 ] [ -1.137545400768e-14 8.33131842816e-15 -1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.499243 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.444558449949806e-18 } }